4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine
TL;DR: 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine (CAS 112163-89-0) is a chemical compound with molecular formula C21H31ClN4O and molecular weight 390.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine
Also Known As: 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine, 1,3,5-Triazin-2-amine, 4-chloro-N,N-dihexyl-6-phenoxy-, N-(4-Chloro-6-phenoxy-1,3,5-triazin-2-yl)-N,N-dihexylamine, N-(4-Chloro-6-phenoxy-1,3,5-triazin-2-yl)-N,N-dihexylamine #, RefChem:291986
| Molecular Formula | C21H31ClN4O |
|---|---|
| Molecular Weight | 390.22 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 390.21863 |
| Heavy Atoms | 27 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 112163-89-0 |
|---|---|
| SMILES | CCCCCCN(CCCCCC)C1=NC(=NC(=N1)Cl)OC2=CC=CC=C2 |
| InChIKey | PYXNTFJNRPCXTF-UHFFFAOYSA-N |
Product Overview
4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine (CAS 112163-89-0), with molecular formula C21H31ClN4O and molecular weight 390.22 g/mol. IUPAC: 4-chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine.
Chemical Property Profile of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine
Property Insights of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine
The XLogP value of 7.9 indicates that 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.1 Ų, 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine?
The CAS number of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine is 112163-89-0.
What is the molecular formula of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine?
The molecular formula of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine is C21H31ClN4O.
What is the molecular weight of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine?
The molecular weight of 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine is 390.22 g/mol.
Where can I buy 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine?
You can request a quote for 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-N,N-dihexyl-6-phenoxy-1,3,5-triazin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.